N-{2-[(2-amino-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{2-[(2-amino-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}thiophene-2-carboxamide
N-{2-[(2-amino-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | D336-6041 |
| Compound Name: | N-{2-[(2-amino-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}thiophene-2-carboxamide |
| Molecular Weight: | 349.45 |
| Molecular Formula: | C14 H11 N3 O2 S3 |
| Smiles: | C(C(N)=O)Sc1nc2ccc(cc2s1)NC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8911 |
| logD: | 2.891 |
| logSw: | -3.3524 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.817 |
| InChI Key: | XSMFIPFOSKCRQG-UHFFFAOYSA-N |